Edogestrone
[CAS# 809-01-8]

Identification

• Name: Edogestrone
• Synonyms: [(8'R,9'S,10'R,13'S,14'S,17'S)-17'-Acetyl-6',10',13'-Trimethyl-Spiro[1,3-Dioxolane-2,3'-2,4,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene]-17'-Yl] Acetate; Acetic Acid [(8'R,9'S,10'R,13'S,14'S,17'S)-17'-Acetyl-6',10',13'-Trimethyl-17'-Spiro[1,3-Dioxolane-2,3'-2,4,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene]Yl] Ester; Acetic Acid [(8'R,9'S,10'R,13'S,14'S,17'S)-17'-Acetyl-6',10',13'-Trimethyl-Spiro[1,3-Dioxolane-2,3'-2,4,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthrene]-17'-Yl] Ester
• Molecular Formula: C₂₆H₃₈O₅
• Molecular Weight: 430.58
• CAS Registry Number: 809-01-8
• SMILES: [C@@]15(C(=C(C[C@@H]2[C@@H]1CC[C@@]3([C@](CC[C@@H]23)(OC(=O)C)C(=O)C)C)C)CC4(OCCO4)CC5)C
• InChI: 1S/C26H38O5/c1-16-14-19-20(23(4)10-11-25(15-22(16)23)29-12-13-30-25)6-8-24(5)21(19)7-9-26(24,17(2)27)31-18(3)28/h19-21H,6-15H2,1-5H3/t19-,20+,21+,23-,24+,26-/m1/s1
• InChIKey: UOYMGHSCINLOBK-BAJLYXPQSA-N

Properties

• Density: 1.166g/cm³ (Cal.)
• Boiling point: 518.224°C at 760 mmHg (Cal.)
• Flash point: 247.923°C (Cal.)